Home Carbonyls (S)-2-(1-(((9H-fluoren-9-yl)methoxy)carbonyl)pyrrolidin-3-yl)acetic acid

(S)-2-(1-(((9H-fluoren-9-yl)methoxy)carbonyl)pyrrolidin-3-yl)acetic acid

CAS No.:
2137082-40-5
Catalog Number:
AG01EL2M
Molecular Formula:
C21H21NO4
Molecular Weight:
351.3957
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Product Description
Catalog Number:
AG01EL2M
Chemical Name:
(S)-2-(1-(((9H-fluoren-9-yl)methoxy)carbonyl)pyrrolidin-3-yl)acetic acid
CAS Number:
2137082-40-5
Molecular Formula:
C21H21NO4
Molecular Weight:
351.3957
MDL Number:
MFCD31559945
IUPAC Name:
2-[(3S)-1-(9H-fluoren-9-ylmethoxycarbonyl)pyrrolidin-3-yl]acetic acid
InChI:
InChI=1S/C21H21NO4/c23-20(24)11-14-9-10-22(12-14)21(25)26-13-19-17-7-3-1-5-15(17)16-6-2-4-8-18(16)19/h1-8,14,19H,9-13H2,(H,23,24)/t14-/m0/s1
InChI Key:
NOVFSLBJPZLTLZ-AWEZNQCLSA-N
SMILES:
OC(=O)C[C@@H]1CCN(C1)C(=O)OCC1c2ccccc2c2c1cccc2
Properties
Complexity:
514  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
351.147g/mol
Formal Charge:
0
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
351.402g/mol
Monoisotopic Mass:
351.147g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties